Core 5 glycan structure
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3D structure from GLYCAM
Cross-references
GlyTouCan : G00039MO
GlyGen : G00039MO
ChEBI : 145577
UniCarb-DB :
Composition
IUPAC
GalNAc(a1-3)GalNAc
GlycoCT
RES 1b:a-dgal-HEX-1:5 2s:n-acetyl 3b:a-dgal-HEX-1:5 4s:n-acetyl LIN 1:1d(2+1)2n 2:1o(3+1)3d 3:3d(2+1)4n
GWS
freeEnd--?a1D-GalNAc,p--3a1D-GalNAc,p$MONO,Und,0,0,freeEnd
Glycam
DGalpNAca1-3DGalpNAca1-OH
SMILES
CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1O[C@@H]2[C@H]([C@H](O[C@@H]([C@@H]2O)CO)O)NC(=O)C)CO)O)O
InCHI key
FJGXDMQHNYEUHI-UBKCYMGWSA-N
InCHI
InChI=1S/C16H28N2O11/c1-5(21)17-9-13(25)11(23)7(3-19)28-16(9)29-14-10(18-6(2)22)15(26)27-8(4-20)12(14)24/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11+,12+,13-,14-,15+,16-/m1/s1